arXiv subjects

T. J. Oliveira

Publications and source records attributed to T. J. Oliveira.

33 records · Page 2Linked to original sources

arXiv2012

Crossover in the scaling of island size and capture zone distributions

Simulations of irreversible growth of extended (fractal and square) islands with critical island sizes i=1 and 2 are performed in broad ranges of coverage θand diffusion-to-deposition ratios R in order to investigate scaling of island size and capture zone area distributions (ISD, CZD). Large θand small R lead to a crossover from the CZD predicted by the theory of Pimpinelli and Einstein (PE), with Gaussian right tail, to CZD with simple exponential decays. The corresponding ISD also cross over from Gaussian or faster decays to simple exponential ones. For fractal islands, these features are explained by changes in the island growth kinetics, from a competition for capture of diffusing adatoms (PE scaling) to aggregation of adatoms with effectively irrelevant diffusion, which is characteristic of random sequential adsorption (RSA) without surface diffusion. This interpretation is confirmed by studying the crossover with similar CZ areas (of order 100 sites) in a model with freezing of diffusing adatoms that corresponds to i=0. For square islands, deviations from PE predictions appear for coverages near θ=0.2 and are mainly related to island coalescence. Our results show that the range of applicability of the PE theory is narrow, thus observing the predicted Gaussian tail of CZD may be difficult in real systems.

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arXiv2011

Universal fluctuations in KPZ growth on one-dimensional flat substrates

We present a numerical study of the evolution of height distributions (HDs) obtained in interface growth models belonging to the Kardar-Parisi-Zhang (KPZ) universality class. The growth is done on an initially flat substrate. The HDs obtained for all investigated models are very well fitted by the theoretically predicted Gaussian Orthogonal Ensemble (GOE) distribution. The first cumulant has a shift that vanishes as $t^{-1/3}$, while the cumulants of order $2\le n\le 4$ converge to GOE as $t^{-2/3}$ or faster, behaviors previously observed in other KPZ systems. These results yield a new evidence for the universality of the GOE distribution in KPZ growth on flat substrates. Finally, we further show that the surfaces are described by the Airy$_{1}$ process.

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arXiv2011

Universal fluctuations in radial growth models belonging to the KPZ universality class

We investigate the radius distributions (RD) of surfaces obtained with large-scale simulations of radial clusters that belong to the KPZ universality class. For all investigated models, the RDs are given by the Tracy-Widom distribution of the Gaussian unitary ensemble, in agreement with the conjecture of the KPZ universality class for curved surfaces. The quantitative agreement was also confirmed by two-point correlation functions asymptotically given by the covariance of the Airy$_2$ process. Our simulation results fill the last lacking gap of the conjecture that had been recently verified analytically and experimentally.

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arXiv2011

Solution on the Bethe lattice of a hard core athermal gas with two kinds of particles

Athermal lattice gases of particles with first neighbor exclusion have been studied for a long time as simple models exhibiting a fluid-solid transition. At low concentration the particles occupy randomly both sublattices, but as the concentration is increased one of the sublattices is occupied preferentially. Here we study a mixed lattice gas with excluded volume interactions only in the grand-canonical formalism with two kinds of particles: small ones, which occupy a single lattice site and large ones, which occupy one site and its first neighbors. We solve the model on a Bethe lattice of arbitrary coordination number $q$. In the parameter space defined by the activities of both particles. At low values of the activity of small particles ($z_1$) we find a continuous transition from the fluid to the solid phase as the activity of large particles ($z_2$) is increased. At higher values of $z_1$ the transition becomes discontinuous, both regimes are separated by a tricritical point. The critical line has a negative slope at $z_1=0$ and displays a minimum before reaching the tricritical point, so that a reentrant behavior is observed for constant values of $z_2$ in the region of low density of small particles. The isobaric curves of the total density of particles as a function of $z_1$ (or $z_2$) show a minimum in the fluid phase.

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arXiv2011

Kinetic modelling of epitaxial film growth with up- and downward step barriers

The formation of three-dimensional structures during the epitaxial growth of films is associated to the reflection of diffusing particles in descending terraces due to the presence of the so-called Ehrlich-Schwoebel (ES) barrier. We generalize this concept in a solid-on-solid growth model, in which a barrier dependent on the particle coordination (number of lateral bonds) exists whenever the particle performs an interlayer diffusion. The rules do not distinguish explicitly if the particle is executing a descending or an ascending interlayer diffusion. We show that the usual model, with a step barrier in descending steps, produces spurious, columnar, and highly unstable morphologies if the growth temperature is varied in a usual range of mound formation experiments. Our model generates well-behaved mounded morphologies for the same ES barriers that produce anomalous morphologies in the standard model. Moreover, mounds are also obtained when the step barrier has an equal value for all particles independently if they are free or bonded. Kinetic roughening is observed at long times, when the surface roughness w and the characteristic length $ξ$ scale as $w ~ t^β$ and $ξ~ t^ζ$ where $β\approx 0.31$ and $ζ\approx 0.22$, independently of the growth temperature.

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arXiv2011

Scaling of island size and capture zone distributions in submonolayer growth

Island size and capture zone distributions (ISDs, CZDs) are studied numerically in submonolayer growth with various critical island sizes and shapes. CZDs scaled by the variance show excellent agreement with the Wigner surmise, confirming the Pimpinelli-Einstein approach for large CZs / large island dynamics. The ISD decay as exp(-s^x), with x=4, x approx 2.4 and 2 for point, fractal, and square islands, respectively. A scaling approach explains the values of x from the Gaussian decay of CZD and the efficiency of islands to capture diffusing adatoms.

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arXiv2011

Roughness exponents and grain shapes

In surfaces with grainy features, the local roughness $w$ shows a crossover at a characteristic length $r_c$, with roughness exponent changing from $α_1\approx 1$ to a smaller $α_2$. The grain shape, the choice of $w$ or height-height correlation function (HHCF) $C$, and the procedure to calculate root mean-square averages are shown to have remarkable effects on $α_1$. With grains of pyramidal shape, $α_1$ can be as low as 0.71, which is much lower than the previous prediction 0.85 for rounded grains. The same crossover is observed in the HHCF, but with initial exponent $χ_1\approx 0.5$ for flat grains, while for some conical grains it may increase to $χ_1\approx 0.7$. The universality class of the growth process determines the exponents $α_2=χ_2$ after the crossover, but has no effect on the initial exponents $α_1$ and $χ_1$, supporting the geometric interpretation of their values. For all grain shapes and different definitions of surface roughness or HHCF, we still observe that the crossover length $r_c$ is an accurate estimate of the grain size. The exponents obtained in several recent experimental works on different materials are explained by those models, with some surface images qualitatively similar to our model films.

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arXiv2010

Bethe lattice solution of a model of SAW's with up to 3 monomers per site and no restriction

In the multiple monomers per site (MMS) model, polymeric chains are represented by walks on a lattice which may visit each site up to K times. We have solved the unrestricted version of this model, where immediate reversals of the walks are allowed (RA) for K = 3 on a Bethe lattice with arbitrary coordination number in the grand-canonical formalism. We found transitions between a non-polymerized and two polymerized phases, which may be continuous or discontinuous. In the canonical situation, the transitions between the extended and the collapsed polymeric phases are always continuous. The transition line is partly composed by tricritical points and partially by critical endpoints, both lines meeting at a multicritical point. In the subspace of the parameter space where the model is related to SASAW's (self-attracting self-avoiding walks), the collapse transition is tricritical. We discuss the relation of our results with simulations and previous Bethe and Husimi lattice calculations for the MMS model found in the literature.

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arXiv2010

Solution of an associating lattice gas model with density anomaly on a Husimi lattice

We study a model of a lattice gas with orientational degrees of freedom which resemble the formation of hydrogen bonds between the molecules. In this model, which is the simplified version of the Henriques-Barbosa model, no distinction is made between donors and acceptors in the bonding arms. We solve the model in the grand-canonical ensemble on a Husimi lattice built with hexagonal plaquettes with a central site. The ground-state of the model, which was originally defined on the triangular lattice, is exactly reproduced by the solution on this Husimi lattice. In the phase diagram, one gas and two liquid (high density-HDL and low density-LDL) phases are present. All phase transitions (GAS-LDL, GAS-HDL, and LDL-HDL) are discontinuous, and the three phases coexist at a triple point. A line of temperatures of maximum density (TMD) in the isobars is found in the metastable GAS phase, as well as another line of temperatures of minimum density (TmD) appears in the LDL phase, part of it in the stable region and another in the metastable region of this phase. These findings are at variance with simulational results for the same model on the triangular lattice, which suggested a phase diagram with two critical points. However, our results show very good quantitative agreement with the simulations, both for the coexistence loci and the densities of particles and of hydrogen bonds. We discuss the comparison of the simulations with our results.

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arXiv2009

Grand canonical and canonical solution of self-avoiding walks with up to three monomers per site on the Bethe lattice

We solve a model of polymers represented by self-avoiding walks on a lattice which may visit the same site up to three times in the grand-canonical formalism on the Bethe lattice. This may be a model for the collapse transition of polymers where only interactions between monomers at the same site are considered. The phase diagram of the model is very rich, displaying coexistence and critical surfaces, critical, critical endpoint and tricritical lines, as well as a multicritical point. From the grand-canonical results, we present an argument to obtain the properties of the model in the canonical ensemble, and compare our results with simulations in the literature. We do actually find extended and collapsed phases, but the transition between them, composed by a line of critical endpoints and a line of tricritical points, separated by the multicritical point, is always continuous. This result is at variance with the simulations for the model, which suggest that part of the line should be a discontinuous transition. Finally, we discuss the connection of the present model with the standard model for the collapse of polymers (self-avoiding self-attracting walks), where the transition between the extended and collapsed phases is a tricritical point.

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arXiv2008

Finite-size effects in roughness distribution scaling

We study numerically finite-size corrections in scaling relations for roughness distributions of various interface growth models. The most common relation, which considers the average roughness $ $ as scaling factor, is not obeyed in the steady states of a group of ballistic-like models in 2+1 dimensions, even when very large system sizes are considered. On the other hand, good collapse of the same data is obtained with a scaling relation that involves the root mean square fluctuation of the roughness, which can be explained by finite-size effects on second moments of the scaling functions. We also obtain data collapse with an alternative scaling relation that accounts for the effect of the intrinsic width, which is a constant correction term previously proposed for the scaling of $ $. This illustrates how finite-size corrections can be obtained from roughness distributions scaling. However, we discard the usual interpretation that the intrinsic width is a consequence of high surface steps by analyzing data of restricted solid-on-solid models with various maximal height differences between neighboring columns. We also observe that large finite-size corrections in the roughness distributions are usually accompanied by huge corrections in height distributions and average local slopes, as well as in estimates of scaling exponents. The molecular-beam epitaxy model of Das Sarma and Tamborenea in 1+1 dimensions is a case example in which none of the proposed scaling relations works properly, while the other measured quantities do not converge to the expected asymptotic values. Thus, although roughness distributions are clearly better than other quantities to determine the universality class of a growing system, it is not the final solution for this task.

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arXiv2008

Solution of a model of SAW's with multiple monomers per site on the Husimi lattice

We solve a model of self-avoiding walks which allows for a site to be visited up to two times by the walk on the Husimi lattice. This model is inspired in the Domb-Joyce model and was proposed to describe the collapse transition of polymers with one-site interactions only. We consider the version in which immediate self-reversals of the walk are forbidden (RF model). The phase diagram we obtain for the grand-canonical version of the model is similar to the one found in the solution of the Bethe lattice, with two distinct polymerized phases, a tricritical point and a critical endpoint.

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arXiv2007

Maximal and minimal height distributions of fluctuating interfaces

We study numerically the maximal and minimal height distributions (MAHD, MIHD) of the nonlinear interface growth equations of second and fourth order and of related lattice models in two dimensions. MAHD and MIHD are different due to the asymmetry of the local height distribution, so that, in each class, the sign of the relevant nonlinear term determines which one of two universal curves is the MAHD and the MIHD. The average maximal and minimal heights scale as the average roughness, in contrast to Edwards-Wilkinson (EW) growth. All extreme height distributions, including the EW ones, have tails that cannot be fit by generalized Gumbel distributions.

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arXiv2007

Effects of grains' features in surface roughness scaling

We study the local and global roughness scaling in growth models with grains at the film surfaces. The local roughness, measured as a function of window size r, shows a crossover at a characteristic length r_c, from a rapid increase with exponent α_1 to a slower increase with exponent α_2. The result α_1\approx 1 is explained by the large height differences in the borders of the grains when compared to intragrain roughness, and must not be interpreted as a consequence of a diffusion dominated intragrain dynamics. This exponent shows a weak dependence on the shape and size distribution of the grains, and typically ranges from 0.85 for rounded grain surfaces to 1 for the sharpest ones. The scaling corrections of exactly solvable models suggest the possibility of slightly smaller values due to other smoothing effects of the surface images. The crossover length r_c provides a reasonable estimate of the average grain size in all model systems, including the cases of wide grain size distributions. In Kardar-Parisi-Zhang growth, very different values of α_2 are obtained, ranging from 0.4 for the films with smoothest surfaces to values in the range 0.1\lesssim α_2 \lesssim 0.2 for systems with large cliffs separating the grains. Possible applications to real systems which show this crossover with similar exponents are discussed.

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arXiv2006

Universal and nonuniversal features in the crossover from linear to nonlinear interface growth

We study a restricted solid-on-solid (RSOS) model involving deposition and evaporation with probabilities p and 1-p, respectively, in one-dimensional substrates. It presents a crossover from Edwards-Wilkinson (EW) to Kardar-Parisi-Zhang (KPZ) scaling for p~0.5. The associated KPZ equation is analytically derived, exhibiting a coefficient lambda of the nonlinear term proportional to q=p-1/2, which is confirmed numerically by calculation of tilt-dependent growth velocities for several values of p. This linear λ-q relation contrasts to the apparently universal parabolic law obtained in competitive models mixing EW and KPZ components. The regions where the interface roughness shows pure EW and KPZ scaling are identified for 0.55<=p<=0.8, which provides numerical estimates of the crossover times t_c. They scale as t_c ~ lambda^(-phi) with phi=4.1+-0.1, which is in excellent agreement with the theoretically predicted universal value phi=4 and improves previous numerical estimates, which suggested phi~3.

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